ar-Curcumen-10,11-diol

Details

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Internal ID d6f382a1-09be-495d-9a44-08bcc06e6008
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name 6-methyl-2-(4-methylphenyl)hept-5-ene-3,4-diol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H22O2/c1-10(2)9-14(16)15(17)12(4)13-7-5-11(3)6-8-13/h5-9,12,14-17H,1-4H3
InChI Key CIGQSFSQDIHCFO-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C15H22O2
Molecular Weight 234.33 g/mol
Exact Mass 234.161979940 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP 3.10

Synonyms

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CIGQSFSQDIHCFO-UHFFFAOYSA-N

2D Structure

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2D Structure of ar-Curcumen-10,11-diol

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 94.20% 85.14%
CHEMBL2581 P07339 Cathepsin D 93.41% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.96% 95.56%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 88.53% 96.09%
CHEMBL3401 O75469 Pregnane X receptor 87.90% 94.73%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 85.41% 94.62%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 84.94% 91.11%
CHEMBL3359 P21462 Formyl peptide receptor 1 83.64% 93.56%
CHEMBL2335 P42785 Lysosomal Pro-X carboxypeptidase 82.27% 100.00%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 81.10% 89.62%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 80.12% 93.65%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Acalypha macrostachya

Cross-Links

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PubChem 6429103
LOTUS LTS0191064
wikiData Q104959784